DL-2-Amino-1-pentanol - CAS 4146-04-7
Catalog: |
BB024889 |
Product Name: |
DL-2-Amino-1-pentanol |
CAS: |
4146-04-7 |
Synonyms: |
2-aminopentan-1-ol |
IUPAC Name: | 2-aminopentan-1-ol |
Description: | DL-2-Amino-1-pentanol (CAS# 4146-04-7 ) is a useful research chemical. |
Molecular Weight: | 103.16 |
Molecular Formula: | C5H13NO |
Canonical SMILES: | CCCC(CO)N |
InChI: | InChI=1S/C5H13NO/c1-2-3-5(6)4-7/h5,7H,2-4,6H2,1H3 |
InChI Key: | ULAXUFGARZZKTK-UHFFFAOYSA-N |
Boiling Point: | 195.6 °C at 760 mmHg |
Purity: | 97 % |
Density: | 0.915 g/cm3 |
MDL: | MFCD00009809 |
LogP: | 0.80640 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22508362 | 20120501 | Pairwise interaction enthalpies of enantiomers of β-amino alcohols in DMSO + H2O mixtures at 298.15 K | Chirality |
Complexity: | 39.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 103.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 103.099714038 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.2 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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